1-piperidin-1-ium-1-ylpropan-2-yl (E)-3-(4-methoxyphenyl)prop-2-enoate chloride

Systemtic Name: 1-piperidin-1-ium-1-ylpropan-2-yl (E)-3-(4-methoxyphenyl)prop-2-enoate chloride Openeye Name: (1-methyl-2-piperidin-1-ium-1-yl-ethyl) (E)-3-(4-methoxyphenyl)prop-2-enoate chloride CAS Name: (E)-3-(4-methoxyphenyl)-2-propenoic acid 1-(1-piperidin-1-iumyl)propan-2-yl ester chloride IUPAC Name: 1-piperidin-1-ium-1-ylpropan-2-yl (E)-3-(4-methoxyphenyl)prop-2-enoate chloride Traditional Name: (E)-3-(4-methoxyphenyl)acrylic acid (1-methyl-2-piperidin-1-ium-1-yl-ethyl) ester chloride Formula: C18H26ClNO3 MolecularWeight: 339.85694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+]1CCCCC1)OC(=O)C=CC2=CC=C(C=C2)OC.[Cl-]

Isomeric SMILES

CC(C[NH+]1CCCCC1)OC(=O)/C=C/C2=CC=C(C=C2)OC.[Cl-]

InChI

InChI=1S/C18H25NO3.ClH/c1-15(14-19-12-4-3-5-13-19)22-18(20)11-8-16-6-9-17(21-2)10-7-16;/h6-11,15H,3-5,12-14H2,1-2H3;1H/b11-8+;